6-(2-bromophenyl)-3-(2,3-dihydro-1,4-benzodioxin-2-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Chemical Structure Depiction of
6-(2-bromophenyl)-3-(2,3-dihydro-1,4-benzodioxin-2-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
6-(2-bromophenyl)-3-(2,3-dihydro-1,4-benzodioxin-2-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Compound characteristics
| Compound ID: | D064-0274 |
| Compound Name: | 6-(2-bromophenyl)-3-(2,3-dihydro-1,4-benzodioxin-2-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole |
| Molecular Weight: | 415.27 |
| Molecular Formula: | C17 H11 Br N4 O2 S |
| Smiles: | C1C(c2nnc3n2nc(c2ccccc2[Br])s3)Oc2ccccc2O1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7192 |
| logD: | 3.7192 |
| logSw: | -4.3472 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 49.159 |
| InChI Key: | ZZRUKGRQQUHDGS-AWEZNQCLSA-N |